bis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+)

C4H10N2O4PtS4+6 — CID 4223018

IUPACbis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+)
SMILESO=[N+]([O-])C=C([SH2+])[SH2+].O=[N+]([O-])C=C([SH2+])[SH2+].[Pt+2]
InChIInChI=1S/2C2H3NO2S2.Pt/c2*4-3(5)1-2(6)7;/h2*1,6-7H;/q;;+2/p+4
InChIKeyOYPKPOIILPZCFC-UHFFFAOYSA-R
MW473.48 g/mol
LogP-1.83
Rot. Bonds2

About bis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+)

bis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+) (PubChem CID 4223018) has the molecular formula C4H10N2O4PtS4+6 and a molecular weight of 473.48 g/mol. Its IUPAC name is bis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+).

Molecular Properties

Compound Namebis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+)
PubChem CID4223018
Molecular FormulaC4H10N2O4PtS4+6
Molecular Weight473.48 g/mol
Exact Mass472.91
IUPAC Namebis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+)
SMILESO=[N+]([O-])C=C([SH2+])[SH2+].O=[N+]([O-])C=C([SH2+])[SH2+].[Pt+2]
InChIInChI=1S/2C2H3NO2S2.Pt/c2*4-3(5)1-2(6)7;/h2*1,6-7H;/q;;+2/p+4
InChIKeyOYPKPOIILPZCFC-UHFFFAOYSA-R
XLogP-1.83
TPSA86.28 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500473.48
LogP ≤ 5-1.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'charged_oxygen_or_sulfur_atoms', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2,3-dimethyl-1,4-dinitrobuta-1,3-diene
CID 71423642
dipotassium;2-nitroethene-1,1-dithiol
CID 136799546
sodium (Z)-1-nitroprop-1-en-2-olate
CID 84818696
2,4-dimethyl-3-(nitromethylidene)pentane
CID 59382813
1-hydrazinyl-2-nitroethenol
CID 4222823
(E)-1-methylsulfanyl-1-methylsulfinyl-2-nitroethene
CID 10130230
tris(platinum(2+));hexanitrate
CID 158036528
(E)-2-iodo-3,3-dimethyl-1-nitrobut-1-ene
CID 134875400
1-nitrobut-1-ene-2-thiol
CID 175323961
1-ethoxy-2-nitroethenol
CID 58981274
platinum(2+);dinitrate;hydrate
CID 172723097
platinum(2+);dinitrate;dihydrate
CID 174146497

Frequently Asked Questions

What is the IUPAC name of bis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+)?
The IUPAC name of bis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+) (CID 4223018) is bis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+).
What is the SMILES notation for bis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+)?
The canonical SMILES for bis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+) is O=[N+]([O-])C=C([SH2+])[SH2+].O=[N+]([O-])C=C([SH2+])[SH2+].[Pt+2].
What is the InChIKey of bis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+)?
The InChIKey is OYPKPOIILPZCFC-UHFFFAOYSA-R. The full InChI is InChI=1S/2C2H3NO2S2.Pt/c2*4-3(5)1-2(6)7;/h2*1,6-7H;/q;;+2/p+4.
What are the key properties of bis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+)?
bis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+) has a molecular weight of 473.48 g/mol, XLogP of -1.83, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis((2-nitro-1-sulfaniumylethenyl)sulfanium);platinum(2+) is sourced from PubChem (CID 4223018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).